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ethyl 2-({[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID GvoGz4Q37iC
InChI InChI=1S/C21H21N3O4S2/c1-2-27-20(26)17-14-10-6-7-11-15(14)30-19(17)22-16(25)12-29-21-24-23-18(28-21)13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3,(H,22,25)
InChIKey QOSALLKAFUUCLA-UHFFFAOYSA-N
Mol Weight 443.54 g/mol
Molecular Formula C21H21N3O4S2
Exact Mass 443.097349 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9BXaHFSG8H9
Name ethyl 2-({[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H21N3O4S2/c1-2-27-20(26)17-14-10-6-7-11-15(14)30-19(17)22-16(25)12-29-21-24-23-18(28-21)13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3,(H,22,25)
InChIKey QOSALLKAFUUCLA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7535
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D48083; Labnumber: SPDEM5-39633; SBI_ID: SBI-007538
Temperature 318 °C